2-[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]-N-(cyclohexylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]-N-(cyclohexylcarbamoyl)ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(cyclohexylcarbamoyl)acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidin-1-iumyl]-N-[(cyclohexylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(cyclohexylcarbamoyl)acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]-N-(cyclohexylcarbamoyl)acetamide Formula: C21H37N4O3+ MolecularWeight: 393.54348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)NC(=O)NC3CCCCC3

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)NC(=O)NC3CCCCC3

InChI

InChI=1S/C21H36N4O3/c26-19(23-21(28)22-18-8-4-3-5-9-18)16-24-14-10-17(11-15-24)20(27)25-12-6-1-2-7-13-25/h17-18H,1-16H2,(H2,22,23,26,28)/p+1